> Jmol developers: > > I've been thinking tonight about the orbital problem. [snip] > I was looking at a cube files and realized that > 99.9% of it is garbage.
Correct. [snip] > OK, so that's 3630 bytes, and THIS IS ALL THAT IS NEEDED TO DISPLAY THE > TWO > SURFACES CONTAINED IN > http://www.stolaf.edu/people/hansonr/jmol/test/proto/ch3cl.cub (3.6 Mb). Excellent! > The line starting with -1 clues us in that this is NOT a > cube file. A cube file here would have a positive number > indicating the number of surfaces in the > file; my number is negative, starting a list of surfaces > in the file, but telling us that this is a JVX file instead. I think that I would recommend a little more distinction between a normal cube file and a JVX cube file. I think that I would put an explicit header at the top ... you can then leave the rest the same in order to share code. This would make it easier for humans to distinguish between the files and would make sure that other software would croak if it tried to read a JVX cube file. > The other numbers on those two lines are the > number of data points and the cutoffs, but they > might be color ranges -- anyway, > there's a line there for some sort of information. > What do we need there? Don't know. > Q: What's the catch? > A: You can't adjust the cutoff. It's going to be *THE* representation of > the > surface for that particular web page. Correct. > What do you think? I think it sounds great. I have no idea how important it is to change cutoffs. Perhaps one could store multiple cutoffs within a single file. Miguel ------------------------------------------------------- Using Tomcat but need to do more? Need to support web services, security? Get stuff done quickly with pre-integrated technology to make your job easier Download IBM WebSphere Application Server v.1.0.1 based on Apache Geronimo http://sel.as-us.falkag.net/sel?cmd=lnk&kid0709&bid&3057&dat1642 _______________________________________________ Jmol-developers mailing list [email protected] https://lists.sourceforge.net/lists/listinfo/jmol-developers
